SCHEMBL1581966

SCHEMBL1581966

O=C(O)C1(c2ccc(S(=O)(=O)CCCO)cc2)CC1C1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.43
GCK P35557 1/20 0.41
HTR7 P34969 1/20 0.37
POLB P06746 3/20 0.35
RAB9A P51151 3/20 0.35
CTDSP1 Q9GZU7 2/20 0.34
LOX P28300 1/20 0.34
NPC1 O15118 2/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
SLC6A2 P23975 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1582299 0.86 GCK (0.45) GCKPOLBRAB9ACTDSP1NPC1
SCHEMBL1581977 0.84 EPHX2 (0.39) GCKHTR7POLBRAB9AKMT2A
SCHEMBL1582479 0.82 ALDH1A1 (0.39) GCKKMT2AALDH1A1CYP3A4CYP2C9
SCHEMBL1582235 0.80 GCK (0.58) GCKKMT2ASMN1; SMN2ALDH1A1
SCHEMBL1581747 0.79 GCK (0.60) GCKKMT2ASMN1; SMN2ALDH1A1
SCHEMBL2654841 0.79 GCK (0.60) GCKKMT2ASMN1; SMN2ALDH1A1
SCHEMBL1344865 0.78 GCK (0.46) GCKKMT2ASMN1; SMN2ALDH1A1CYP2C9
SCHEMBL1582297 0.76 GCK (0.47) GCKPOLBKMT2AALDH1A1CYP3A4
SCHEMBL1581983 0.76 GCK (0.49) GCKPOLBKMT2ASMN1; SMN2ALDH1A1
SCHEMBL1581938 0.75 NAMPT (0.42) GCKSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1585739-B1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS LILLY CO ELI (US) 2011-04-20 EP disclosed
US-7576108-B2 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY (US) 2009-08-18 US disclosed
US-20060111353-A1 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY 2006-05-25 US disclosed
EP-1585739-A1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS ELI LILLY AND COMPANY (US) 2005-10-19 EP disclosed
WO-2004063179-A1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS ELI LILLY AND COMPANY (US) 2004-07-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060111353-A1 Substituted arylcyclopropylacetamides as glucokinase activators GCK, GCKR, GALK1 CA2 1004/4885GCK 1/4885HTR7 2079/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.